Cyclopentyl trifluoroacetate
Basic information
- CAS
703-13-9- Standard SMILES
O=C(OC1CCCC1)C(F)(F)F- InChIKey
QCONYJQZFUESJD-UHFFFAOYSA-N- Molecular formula
- C7H9F3O2
- Average molar mass
- 182.14 g/mol
- Monoisotopic mass
- 182.05546401
Names & identifiers
- Preferred name
- Cyclopentyl trifluoroacetate
- IUPAC
- cyclopentyl 2,2,2-trifluoroacetate
- English name
- Cyclopentyl trifluoroacetate
- Molecular formula
- C7H9F3O2
- Molecular weight
- 182.14
Names & synonyms
Cyclopentyl trifluoroacetate703-13-9Trifluoroacetic acid, cyclopentyl esterDTXSID20334935Acetic acid, trifluoro-, cyclopentyl esterRefChem:336095DTXCID00286024QCONYJQZFUESJD-UHFFFAOYSA-Ncyclopentyl 2,2,2-trifluoroacetateCyclopentyltrifluoroacetateMFCD007809321-[(Trifluoroacetyl)oxy]cyclopentane
Show more names
Cyclopentyl trifluoroacetate 97+%Acetic acid, 2,2,2-trifluoro-, cyclopentyl ester
Cyclopentyl trifluoroacetate #SCHEMBL27976432SBB089866AKOS006275325DB-055404
Database identifiers
- CAS
703-13-9- PubChem CID
- 522379
- DTXSID
DTXSID20334935- Nikkaji
- J1.102.728H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Boiling point
- 144.6 · 144.6±35.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- HS Code
- 2916200090 · 2916200090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2916200090
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Related reactions
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Compound notes
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